(2R)-2-[(2S)-2-[(2S)-2-amino-6-[(2,3-dihydroxyphenyl)formamido]hexanamido]-6-[(2,3-dihydroxyphenyl)formamido]hexanamido]-3-[(3S)-3H-indol-3-yl]propanoic acid
AlkaPlorer ID: AK185686
Synonym: None
IUPAC Name: (2R)-2-[[(2S)-2-[[(2S)-2-amino-6-[(2,3-dihydroxybenzoyl)amino]hexanoyl]amino]-6-[(2,3-dihydroxybenzoyl)amino]hexanoyl]amino]-3-[(3S)-3H-indol-3-yl]propanoic acid
Structure
SMILES: N[C@@H](CCCCN=C(O)C1=CC=CC(O)=C1O)C(O)=N[C@@H](CCCCN=C(O)C1=CC=CC(O)=C1O)C(O)=N[C@H](C[C@@H]1C=NC2=CC=CC=C21)C(=O)O
InChI: InChI=1S/C37H44N6O10/c38-25(12-3-5-17-39-33(48)23-10-7-15-29(44)31(23)46)35(50)42-27(14-4-6-18-40-34(49)24-11-8-16-30(45)32(24)47)36(51)43-28(37(52)53)19-21-20-41-26-13-2-1-9-22(21)26/h1-2,7-11,13,15-16,20-21,25,27-28,44-47H,3-6,12,14,17-19,38H2,(H,39,48)(H,40,49)(H,42,50)(H,43,51)(H,52,53)/t21-,25+,27+,28-/m1/s1
InChIKey: UBPGEGIGRJTYJH-NZHOUOPXSA-N
Reference
Amonabactin: Characterization of a Series of Siderophores from Aeromonas hydrophila
PubChem CID: 162982897
LOTUS: LTS0037555
SuperNatural Ⅲ: SN0366016-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aeromonas hydrophila | Aeromonas | Aeromonadaceae | Aeromonadales | Gammaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 732.7910000000003
TPSA？: 286.96000000000004
MolLogP？: 5.110900000000004
Number of H-Donors: 10
Number of H-Acceptors: 11
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|